2-(3-cyclopentyloxy-4-methoxy-phenyl)-2-(hydroxymethyl)-3-phenyl-propanenitrile

Systemtic Name: 2-(3-cyclopentyloxy-4-methoxy-phenyl)-2-(hydroxymethyl)-3-phenyl-propanenitrile Openeye Name: 2-benzyl-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-hydroxy-propanenitrile CAS Name: 2-(3-cyclopentyloxy-4-methoxyphenyl)-2-(hydroxymethyl)-3-phenylpropanenitrile IUPAC Name: 2-benzyl-2-(3-cyclopentyloxy-4-methoxyphenyl)-3-hydroxypropanenitrile Traditional Name: 2-benzyl-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-hydroxy-propionitrile Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC2=CC=CC=C2)(CO)C#N)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC2=CC=CC=C2)(CO)C#N)OC3CCCC3

InChI

InChI=1S/C22H25NO3/c1-25-20-12-11-18(13-21(20)26-19-9-5-6-10-19)22(15-23,16-24)14-17-7-3-2-4-8-17/h2-4,7-8,11-13,19,24H,5-6,9-10,14,16H2,1H3